COMPOUND: C22067


Entry
C22067                      Compound                               
Name
3'-(beta-D-Glucopyranosyl)-2'-hydroxy-beta-oxodihydrochalcone
Formula
C21H22O8
Exact mass
402.1315
Mol weight
402.3946
Structure
Comment
Generic compound in reaction hierarchy
Reaction
R12290
Enzyme
2.4.1.360
Brite
Glycosides [BR:br08021]
 O-glycosides
  Chalcone glycosides
   C22067  3'-(beta-D-Glucopyranosyl)-2'-hydroxy-beta-oxodihydrochalcone
Other DBs
PubChem: 384585127
KCF data

ATOM        29
            1   C8y C    16.2400  -16.2400
            2   C5a C    17.5000  -16.9400
            3   C8y C    16.2400  -14.7700
            4   C8x C    15.0500  -16.9400
            5   O5a O    17.5000  -18.3400
            6   C8y C    15.0500  -14.0700
            7   O1a O    17.5000  -14.0700
            8   C8x C    13.8600  -16.2400
            9   C8x C    13.8600  -14.7700
            10  C1b C    18.6900  -16.2400
            11  C5a C    19.9500  -16.9400
            12  C8y C    21.0000  -16.2400
            13  C8x C    22.1900  -16.9400
            14  C8x C    23.4500  -16.2400
            15  C8x C    23.4500  -14.8400
            16  C8x C    22.2600  -14.1400
            17  C8x C    21.0000  -14.8400
            18  O5a O    19.8800  -18.3400
            19  C1y C    15.0500  -12.6700
            20  O2x O    16.2400  -11.9000
            21  C1y C    16.2400  -10.5000
            22  C1y C    14.9800   -9.8700
            23  C1y C    13.7900  -10.5700
            24  C1y C    13.7900  -11.9700
            25  C1b C    17.4300   -9.7300
            26  O1a O    17.3600   -8.3300
            27  O1a O    14.9800   -8.4000
            28  O1a O    12.6000   -9.8700
            29  O1a O    12.6700  -12.6700
BOND        31
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     3   7 1
            7     4   8 2
            8     6   9 2
            9     8   9 1
            10    2  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   12  17 1
            19   11  18 2
            20   19  20 1
            21   20  21 1
            22   21  22 1
            23   22  23 1
            24   23  24 1
            25   19  24 1
            26   21  25 1 #Up
            27   25  26 1
            28   22  27 1 #Down
            29   23  28 1 #Up
            30   24  29 1 #Down
            31   19   6 1 #Up

» Japanese version

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Chemical substance (1)   
   PubChem (1)   
Chemical reaction (2)   
   KEGG ENZYME (1)   
   KEGG REACTION (1)   
All databases (3)   

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